7-(2,8-diazaspiro[4.5]decan-8-yl)-5-[[5-(4-hydroxypiperidin-1-yl)-2-pyridinyl]amino]-3H-1,8-naphthyridin-4-one

C26H33N7O2 — CID 175872393

IUPAC7-(2,8-diazaspiro[4.5]decan-8-yl)-5-[[5-(4-hydroxypiperidin-1-yl)-2-pyridinyl]amino]-3H-1,8-naphthyridin-4-one
SMILESO=C1CC=Nc2nc(N3CCC4(CCNC4)CC3)cc(Nc3ccc(N4CCC(O)CC4)cn3)c21
InChIInChI=1S/C26H33N7O2/c34-19-4-11-32(12-5-19)18-1-2-22(29-16-18)30-20-15-23(31-25-24(20)21(35)3-9-28-25)33-13-7-26(8-14-33)6-10-27-17-26/h1-2,9,15-16,19,27,34H,3-8,10-14,17H2,(H,29,30,31)
InChIKeyUPOBRHCWPPUAPG-UHFFFAOYSA-N
MW475.60 g/mol
LogP3.05
Rot. Bonds4

About 7-(2,8-diazaspiro[4.5]decan-8-yl)-5-[[5-(4-hydroxypiperidin-1-yl)-2-pyridinyl]amino]-3H-1,8-naphthyridin-4-one

7-(2,8-diazaspiro[4.5]decan-8-yl)-5-[[5-(4-hydroxypiperidin-1-yl)-2-pyridinyl]amino]-3H-1,8-naphthyridin-4-one (PubChem CID 175872393) has the molecular formula C26H33N7O2 and a molecular weight of 475.60 g/mol. Its IUPAC name is 7-(2,8-diazaspiro[4.5]decan-8-yl)-5-[[5-(4-hydroxypiperidin-1-yl)-2-pyridinyl]amino]-3H-1,8-naphthyridin-4-one.

Molecular Properties

Compound Name7-(2,8-diazaspiro[4.5]decan-8-yl)-5-[[5-(4-hydroxypiperidin-1-yl)-2-pyridinyl]amino]-3H-1,8-naphthyridin-4-one
PubChem CID175872393
Molecular FormulaC26H33N7O2
Molecular Weight475.60 g/mol
Exact Mass475.27
IUPAC Name7-(2,8-diazaspiro[4.5]decan-8-yl)-5-[[5-(4-hydroxypiperidin-1-yl)-2-pyridinyl]amino]-3H-1,8-naphthyridin-4-one
SMILESO=C1CC=Nc2nc(N3CCC4(CCNC4)CC3)cc(Nc3ccc(N4CCC(O)CC4)cn3)c21
InChIInChI=1S/C26H33N7O2/c34-19-4-11-32(12-5-19)18-1-2-22(29-16-18)30-20-15-23(31-25-24(20)21(35)3-9-28-25)33-13-7-26(8-14-33)6-10-27-17-26/h1-2,9,15-16,19,27,34H,3-8,10-14,17H2,(H,29,30,31)
InChIKeyUPOBRHCWPPUAPG-UHFFFAOYSA-N
XLogP3.05
TPSA105.98 Ų
H-Bond Donors3
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500475.60
LogP ≤ 53.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 109

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Related Compounds

2-(2,6-difluorophenyl)-4-[[5-(4-hydroxypiperidin-1-yl)-2-pyridinyl]amino]-6,7-dihydropyrrolo[3,4-b]pyridin-5-one
CID 118341365
1-[6-[(5-cyclopropyl-2-pyridinyl)amino]-4-piperazin-1-yl-2-pyridinyl]piperidin-4-ol
CID 177317959
4-[[5-(4-hydroxypiperidin-1-yl)-2-pyridinyl]amino]-2-[(3-methyloxetan-3-yl)methyl]-6H-1,6-naphthyridin-5-one
CID 164882854
8-(4-fluorophenyl)-2,8-diazaspiro[4.5]decane
CID 59505678
1-[6-[(5-cyclopropyl-2-pyridinyl)amino]-4-piperazin-1-yl-2-pyridinyl]pyrrolidin-3-ol
CID 177317932
4-fluoro-3-[4-[[5-(4-hydroxypiperidin-1-yl)-2-pyridinyl]amino]-5-oxo-6H-1,6-naphthyridin-2-yl]benzonitrile
CID 164882839
2-(2-fluoro-6-methoxyphenyl)-4-[[5-(4-hydroxypiperidin-1-yl)-2-pyridinyl]amino]-6H-1,6-naphthyridin-5-one
CID 164883062
ethane;1-oxo-7-[(5-piperazin-1-yl-2-pyridinyl)amino]-2,3-dihydropyrrolo[3,4-c]pyridine-4-carboxamide
CID 164926987
N-(5-piperazin-1-yl-2-pyridinyl)-6-piperidin-1-ylimidazo[1,2-b]pyridazin-8-amine
CID 70878752
2-[4-(azetidine-1-carbonyl)-2-fluorophenyl]-4-[[5-(4-hydroxypiperidin-1-yl)-2-pyridinyl]amino]-6H-1,6-naphthyridin-5-one
CID 164882741
5-bromo-3-[[5-(3-hydroxyazetidin-1-yl)-2-pyridinyl]amino]-1-methylpyridin-2-one
CID 58043923
2-[2-fluoro-4-(piperidin-1-ylmethyl)phenyl]-4-[[5-(4-hydroxypiperidin-1-yl)-2-pyridinyl]amino]-6H-1,6-naphthyridin-5-one
CID 164882898

Frequently Asked Questions

What is the IUPAC name of 7-(2,8-diazaspiro[4.5]decan-8-yl)-5-[[5-(4-hydroxypiperidin-1-yl)-2-pyridinyl]amino]-3H-1,8-naphthyridin-4-one?
The IUPAC name of 7-(2,8-diazaspiro[4.5]decan-8-yl)-5-[[5-(4-hydroxypiperidin-1-yl)-2-pyridinyl]amino]-3H-1,8-naphthyridin-4-one (CID 175872393) is 7-(2,8-diazaspiro[4.5]decan-8-yl)-5-[[5-(4-hydroxypiperidin-1-yl)-2-pyridinyl]amino]-3H-1,8-naphthyridin-4-one.
What is the SMILES notation for 7-(2,8-diazaspiro[4.5]decan-8-yl)-5-[[5-(4-hydroxypiperidin-1-yl)-2-pyridinyl]amino]-3H-1,8-naphthyridin-4-one?
The canonical SMILES for 7-(2,8-diazaspiro[4.5]decan-8-yl)-5-[[5-(4-hydroxypiperidin-1-yl)-2-pyridinyl]amino]-3H-1,8-naphthyridin-4-one is O=C1CC=Nc2nc(N3CCC4(CCNC4)CC3)cc(Nc3ccc(N4CCC(O)CC4)cn3)c21.
What is the InChIKey of 7-(2,8-diazaspiro[4.5]decan-8-yl)-5-[[5-(4-hydroxypiperidin-1-yl)-2-pyridinyl]amino]-3H-1,8-naphthyridin-4-one?
The InChIKey is UPOBRHCWPPUAPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H33N7O2/c34-19-4-11-32(12-5-19)18-1-2-22(29-16-18)30-20-15-23(31-25-24(20)21(35)3-9-28-25)33-13-7-26(8-14-33)6-10-27-17-26/h1-2,9,15-16,19,27,34H,3-8,10-14,17H2,(H,29,30,31).
What are the key properties of 7-(2,8-diazaspiro[4.5]decan-8-yl)-5-[[5-(4-hydroxypiperidin-1-yl)-2-pyridinyl]amino]-3H-1,8-naphthyridin-4-one?
7-(2,8-diazaspiro[4.5]decan-8-yl)-5-[[5-(4-hydroxypiperidin-1-yl)-2-pyridinyl]amino]-3H-1,8-naphthyridin-4-one has a molecular weight of 475.60 g/mol, XLogP of 3.05, 4 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2,8-diazaspiro[4.5]decan-8-yl)-5-[[5-(4-hydroxypiperidin-1-yl)-2-pyridinyl]amino]-3H-1,8-naphthyridin-4-one is sourced from PubChem (CID 175872393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).